1-(4-chlorophenyl)-N-(2,3-dimethylphenyl)methanesulfonamide

C15H16ClNO2S — CID 18891284

IUPAC1-(4-chlorophenyl)-N-(2,3-dimethylphenyl)methanesulfonamide
SMILESCc1cccc(NS(=O)(=O)Cc2ccc(Cl)cc2)c1C
InChIInChI=1S/C15H16ClNO2S/c1-11-4-3-5-15(12(11)2)17-20(18,19)10-13-6-8-14(16)9-7-13/h3-9,17H,10H2,1-2H3
InChIKeySVEGSKGCIMVEIK-UHFFFAOYSA-N
MW309.82 g/mol
LogP3.90
Rot. Bonds4

About 1-(4-chlorophenyl)-N-(2,3-dimethylphenyl)methanesulfonamide

1-(4-chlorophenyl)-N-(2,3-dimethylphenyl)methanesulfonamide (PubChem CID 18891284) has the molecular formula C15H16ClNO2S and a molecular weight of 309.82 g/mol. Its IUPAC name is 1-(4-chlorophenyl)-N-(2,3-dimethylphenyl)methanesulfonamide.

Molecular Properties

Compound Name1-(4-chlorophenyl)-N-(2,3-dimethylphenyl)methanesulfonamide
PubChem CID18891284
Molecular FormulaC15H16ClNO2S
Molecular Weight309.82 g/mol
Exact Mass309.06
IUPAC Name1-(4-chlorophenyl)-N-(2,3-dimethylphenyl)methanesulfonamide
SMILESCc1cccc(NS(=O)(=O)Cc2ccc(Cl)cc2)c1C
InChIInChI=1S/C15H16ClNO2S/c1-11-4-3-5-15(12(11)2)17-20(18,19)10-13-6-8-14(16)9-7-13/h3-9,17H,10H2,1-2H3
InChIKeySVEGSKGCIMVEIK-UHFFFAOYSA-N
XLogP3.90
TPSA46.17 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500309.82
LogP ≤ 53.90
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1-chloro-N-(2,3-dimethylphenyl)methanesulfonamide
CID 63665725
1-(4-chlorophenyl)-N-(2-methylsulfanylphenyl)methanesulfonamide
CID 18891408
1-(4-chlorophenyl)-N-(3-methylphenyl)methanesulfonamide
CID 18891258
N-(5-chloro-2-methylphenyl)-1-phenylmethanesulfonamide
CID 788792
1-(4-chlorophenyl)-N-[2-(8-methylimidazo[1,2-a]pyridin-2-yl)phenyl]methanesulfonamide
CID 121149174
1-(2-aminophenyl)-N-(2,3-dimethylphenyl)methanesulfonamide
CID 62021830
1-(4-chlorophenyl)-N-(2,5-dichlorophenyl)methanesulfonamide
CID 18891286
2-[(4-chlorophenyl)methylsulfonylamino]benzamide
CID 2227897
1-(4-chlorophenyl)-N-(2,3-dimethylimidazo[1,2-a]pyridin-8-yl)methanesulfonamide
CID 110735475
1-(4-methoxyphenyl)-N-(2-methylphenyl)methanesulfonamide
CID 127510090
1-[4-(aminomethyl)phenyl]-N-(2-chloro-6-methylphenyl)methanesulfonamide
CID 106070690
1-[3-[(4-chlorophenyl)methylsulfonyl]-4-methylphenyl]-3-(2,3-dimethylphenyl)urea
CID 159707443

Frequently Asked Questions

What is the IUPAC name of 1-(4-chlorophenyl)-N-(2,3-dimethylphenyl)methanesulfonamide?
The IUPAC name of 1-(4-chlorophenyl)-N-(2,3-dimethylphenyl)methanesulfonamide (CID 18891284) is 1-(4-chlorophenyl)-N-(2,3-dimethylphenyl)methanesulfonamide.
What is the SMILES notation for 1-(4-chlorophenyl)-N-(2,3-dimethylphenyl)methanesulfonamide?
The canonical SMILES for 1-(4-chlorophenyl)-N-(2,3-dimethylphenyl)methanesulfonamide is Cc1cccc(NS(=O)(=O)Cc2ccc(Cl)cc2)c1C.
What is the InChIKey of 1-(4-chlorophenyl)-N-(2,3-dimethylphenyl)methanesulfonamide?
The InChIKey is SVEGSKGCIMVEIK-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H16ClNO2S/c1-11-4-3-5-15(12(11)2)17-20(18,19)10-13-6-8-14(16)9-7-13/h3-9,17H,10H2,1-2H3.
What are the key properties of 1-(4-chlorophenyl)-N-(2,3-dimethylphenyl)methanesulfonamide?
1-(4-chlorophenyl)-N-(2,3-dimethylphenyl)methanesulfonamide has a molecular weight of 309.82 g/mol, XLogP of 3.90, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(4-chlorophenyl)-N-(2,3-dimethylphenyl)methanesulfonamide is sourced from PubChem (CID 18891284), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).